175203-98-2
Product Name:
2-[(3-METHYLBENZO[B]THIOPHEN-2-YL)CARBONYL]BENZOIC ACID
Formula:
C17H12O3S
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COMPUTED DESCRIPTORS
Molecular Weight | 296.3 g/mol |
---|---|
XLogP3 | 4.5 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 3 |
Exact Mass | 296.05071541 g/mol |
Monoisotopic Mass | 296.05071541 g/mol |
Topological Polar Surface Area | 82.6 Ų |
Heavy Atom Count | 21 |
Formal Charge | 0 |
Complexity | 422 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |